Dimethyl Sulfoxide → 3-ethoxycarbonyl-4-trifluoromethyl-1-(isoquinolin-1-yl)-1H-pyrrole

Reaction equation

[C:26](=[O:27])([O-:28])[O-:29].[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[c:6]1[cH:7][nH:8][cH:9][c:10]1[C:11]([F:12])([F:13])[F:14].[CH3:32][S:33](=[O:34])[CH3:35].[Cl:15][c:16]1[n:17][cH:18][cH:19][c:20]2[cH:21][cH:22][cH:23][cH:24][c:25]12.[K+:30].[K+:31].[OH2:36]>>[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[c:6]1[cH:7][n:8](-[c:16]2[n:17][cH:18][cH:19][c:20]3[cH:21][cH:22][cH:23][cH:24][c:25]23)[cH:9][c:10]1[C:11]([F:12])([F:13])[F:14]

Participants

Reactant 6

HCID 679Dimethyl Sulfoxide

HCID 813Potassium Cation2×

HCID 962Water

HCID 19660Carbonate Ion

HCID 140539Isoquinoline, 1-chloro-

HCID 14370786ethyl 4-(trifluoromethyl)-1H-pyrrole-3-carboxylate

Product 1

HCID 22024950

Sources & evidence

ORD record: ord-95ea80cece3f4de582674c5cbb93af6c
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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